2-bromanyl-N-[(2-indol-1-ylethanoylamino)carbamothioyl]benzamide

Systemtic Name: 2-bromanyl-N-[(2-indol-1-ylethanoylamino)carbamothioyl]benzamide Openeye Name: 2-bromo-N-[[(2-indol-1-ylacetyl)amino]carbamothioyl]benzamide CAS Name: 2-bromo-N-[[[2-(1-indolyl)-1-oxoethyl]hydrazo]-sulfanylidenemethyl]benzamide IUPAC Name: 2-bromo-N-[[(2-indol-1-ylacetyl)amino]carbamothioyl]benzamide Traditional Name: 2-bromo-N-[[(2-indol-1-ylacetyl)amino]thiocarbamoyl]benzamide Formula: C18H15BrN4O2S MolecularWeight: 431.3063

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=CN2CC(=O)NNC(=S)NC(=O)C3=CC=CC=C3Br

Isomeric SMILES

C1=CC=C2C(=C1)C=CN2CC(=O)NNC(=S)NC(=O)C3=CC=CC=C3Br

InChI

InChI=1S/C18H15BrN4O2S/c19-14-7-3-2-6-13(14)17(25)20-18(26)22-21-16(24)11-23-10-9-12-5-1-4-8-15(12)23/h1-10H,11H2,(H,21,24)(H2,20,22,25,26)